dicyclohexyl[2-(2-methoxyphenyl)phenyl]phosphane

• ChemBase ID: 289326
• Molecular Formular: C25H33OP
• Molecular Mass: 380.502681
• Monoisotopic Mass: 380.22690231
• SMILES: COc1ccccc1c1ccccc1P(C1CCCCC1)C1CCCCC1
• Canonical SMILES: COc1ccccc1c1ccccc1P(C1CCCCC1)C1CCCCC1
• InChI: InChI=1S/C25H33OP/c1-26-24-18-10-8-16-22(24)23-17-9-11-19-25(23)27(20-12-4-2-5-13-20)21-14-6-3-7-15-21/h8-11,16-21H,2-7,12-15H2,1H3
• InChIKey: YXJPHYNYXMEWKW-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: dicyclohexyl[2-(2-methoxyphenyl)phenyl]phosphane
• IUPAC Traditional name: dicyclohexyl[2-(2-methoxyphenyl)phenyl]phosphane
• Synonyms: Dicyclohexyl(2'-methoxy-[1,1'-biphenyl]-2-yl)phosphine

Database IDs

• CAS Number: 255835-82-6
• MDL Number: MFCD19441234
• PubChem SID: 180674857
• PubChem CID: 11794186

CALCULATED PROPERTIES

• H Acceptors: 1
• H Donor: 0
• LogD (pH = 5.5): 6.184387
• LogD (pH = 7.4): 6.4150467
• Log P: 6.5601
• Molar Refractivity: 115.5971 cm^3
• Polarizability: 47.27298 Å^3
• Polar Surface Area: 9.23 Å^2
• Rotatable Bonds: 5
• Lipinski's Rule of Five: false

PROPERTIES

Product Information

• Purity: 95+%